(4-tert-butylphenyl)methyl (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate

Systemtic Name: (4-tert-butylphenyl)methyl (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Openeye Name: (4-tert-butylphenyl)methyl (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propenoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1,3,5-trimethylpyrazol-4-yl)acrylic acid (4-tert-butylbenzyl) ester Formula: C20H26N2O2 MolecularWeight: 326.43264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)OCC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)OCC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H26N2O2/c1-14-18(15(2)22(6)21-14)11-12-19(23)24-13-16-7-9-17(10-8-16)20(3,4)5/h7-12H,13H2,1-6H3/b12-11+